| Properties | Image |
|---|
| MNX_ID | MNXM1192688 |
 |
| reference | envipathM:...0656469ff7e7 |
| formula | C41H64O17 |
| global charge | 0 |
| mol weight | 828.946 |
| InChIKey | PEVHKXCIKMXGGN-UHFFFAOYSA-N |
| InChI | InChI=1S/C41H64O17/c1-17-25(42)10-23-22(26(43)11-28(45)36(17)41(51)15-32(49)52-16-41)9-27(44)24-8-21(6-7-40(23,24)5)56-33-13-30(47)38(19(3)54-33)58-35-14-31(48)39(20(4)55-35)57-34-12-29(46)37(50)18(2)53-34/h17-24,27-31,33-39,44-48,50-51H,6-16H2,1-5H3 |
| SMILES | CC1OC(OC2C(O)CC(OC3C(O)CC(OC4CCC5(C)C(C4)C(O)CC4C(=O)CC(O)C(C6(O)COC(=O)C6)C(C)C(=O)CC45)OC3C)OC2C)CC(O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C41H64O17/c1-17-25(42)10-23-22(26(43)11-28(45)36(17)41(51)15-32(49)52-16-41)9-27(44)24-8-21(6-7-40(23,24)5)56-33-13-30(47)38(19(3)54-33)58-35-14-31(48)39(20(4)55-35)57-34-12-29(46)37(50)18(2)53-34/h17-24,27-31,33-39,44-48,50-51H,6-16H2,1-5H3/t17?,18?,19?,20?,21?,22?,23?,24?,27?,28?,29?,30?,31?,33?,34?,35?,36?,37?,38?,39?,40?,41? |
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| SMILES (mnx) | [CH3:1][CH:17]1[C:25](=[O:42])[CH2:10][CH:23]2[CH:22]([CH2:9][CH:27]([OH:44])[CH:24]3[CH2:8][CH:21]([O:56][CH:33]4[CH2:13][CH:30]([OH:47])[CH:38]([O:58][CH:35]5[CH2:14][CH:31]([OH:48])[CH:39]([O:57][CH:34]6[CH2:12][CH:29]([OH:46])[CH:37]([OH:50])[CH:18]([CH3:2])[O:53]6)[CH:20]([CH3:4])[O:55]5)[CH:19]([CH3:3])[O:54]4)[CH2:6][CH2:7][C:40]23[CH3:5])[C:26](=[O:43])[CH2:11][CH:28]([OH:45])[CH:36]1[C:41]1([OH:51])[CH2:15][C:32](=[O:49])[O:52][CH2:16]1 |
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